ethyl 2-[[3-ethoxy-4-[(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)amino]phenyl]methylideneamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-ethoxy-4-[(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)amino]phenyl]methylideneamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[3-ethoxy-4-[(2-oxo-2-pyrrolidin-1-yl-ethyl)amino]phenyl]methyleneamino]benzothiophene-3-carboxylate CAS Name: 2-[[3-ethoxy-4-[[2-oxo-2-(1-pyrrolidinyl)ethyl]amino]phenyl]methylideneamino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-ethoxy-4-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]phenyl]methylideneamino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[3-ethoxy-4-[(2-keto-2-pyrrolidino-ethyl)amino]benzylidene]amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NC2=C(C3=CC=CC=C3S2)C(=O)OCC)NCC(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=NC2=C(C3=CC=CC=C3S2)C(=O)OCC)NCC(=O)N4CCCC4

InChI

InChI=1S/C26H29N3O4S/c1-3-32-21-15-18(11-12-20(21)27-17-23(30)29-13-7-8-14-29)16-28-25-24(26(31)33-4-2)19-9-5-6-10-22(19)34-25/h5-6,9-12,15-16,27H,3-4,7-8,13-14,17H2,1-2H3